2-azanyl-4-sulfanyl-butanoic acid; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 2-azanyl-4-sulfanyl-butanoic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: 2-amino-4-sulfanyl-butanoic acid; 2-(trimethylammonio)acetate CAS Name: 2-amino-4-mercaptobutanoic acid; 2-(trimethylammonio)acetate IUPAC Name: 2-amino-4-sulfanylbutanoic acid; 2-(trimethylazaniumyl)acetate Traditional Name: 2-amino-4-mercapto-butyric acid; 2-(trimethylammonio)acetate Formula: C9H20N2O4S MolecularWeight: 252.3311

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(=O)[O-].C(CS)C(C(=O)O)N

Isomeric SMILES

C[N+](C)(C)CC(=O)[O-].C(CS)C(C(=O)O)N

InChI

InChI=1S/C5H11NO2.C4H9NO2S/c1-6(2,3)4-5(7)8;5-3(1-2-8)4(6)7/h4H2,1-3H3;3,8H,1-2,5H2,(H,6,7)